Structure Information
Structure

Compound Identification

SMILES

NC1=C(N=NC2=C(C=C(C=C2)C2=CC(C(O)=O)=C(NC(=O)NC3=CC4=C(O)C(N=NC5=CC=C(N=NC6=CC(C(O)=O)=C(O)C=C6)C6=CC=CC=C56)=C(C=C4C=C3)S(O)(=O)=O)C=C2)C(O)=O)C(=CC2=CC(=CC(O)=C12)S(O)(=O)=O)S(O)(=O)=O

InChIKey

InChIKey=MUKHPKCBDWFBCC-UHFFFAOYSA-N

Formula

C52H35N9O19S3

Mass

1186.08

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalene sulfonic acids and derivatives

Intermediate Tree Nodes

Naphthalene sulfonates

Direct Parent

2-naphthalene sulfonates

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

2-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - Biphenyl - 1-naphthol - N-phenylurea - Hydroxybenzoic acid - Salicylic acid or derivatives - Salicylic acid - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Benzoic acid - Benzoic acid or derivatives - Benzoyl - 1-hydroxy-4-unsubstituted benzenoid - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Vinylogous amide - Vinylogous acid - Urea - Amino acid - Azo compound - Amino acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Carbonyl group - Organosulfur compound - Primary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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